[2-(diphenylphosphorylmethyl)phenyl] 3-nitrobenzoate

Systemtic Name: [2-(diphenylphosphorylmethyl)phenyl] 3-nitrobenzoate Openeye Name: [2-(diphenylphosphorylmethyl)phenyl] 3-nitrobenzoate CAS Name: 3-nitrobenzoic acid [2-(diphenylphosphorylmethyl)phenyl] ester IUPAC Name: [2-(diphenylphosphorylmethyl)phenyl] 3-nitrobenzoate Traditional Name: 3-nitrobenzoic acid [2-(diphenylphosphorylmethyl)phenyl] ester Formula: C26H20NO5P MolecularWeight: 457.414461

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)P(=O)(CC2=CC=CC=C2OC(=O)C3=CC(=CC=C3)[N+](=O)[O-])C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)P(=O)(CC2=CC=CC=C2OC(=O)C3=CC(=CC=C3)[N+](=O)[O-])C4=CC=CC=C4

InChI

InChI=1S/C26H20NO5P/c28-26(20-11-9-12-22(18-20)27(29)30)32-25-17-8-7-10-21(25)19-33(31,23-13-3-1-4-14-23)24-15-5-2-6-16-24/h1-18H,19H2